SCHEMBL8080372

SCHEMBL8080372

COc1ccc2cc3c(c(-c4ccc(C)cc4)c2c1)C(=O)NC3=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.46
MAOB P27338 5/20 0.45
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
LMNA P02545 1/20 0.45
HPGD P15428 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
CDK1 P06493 1/20 0.44
CLK1 P49759 1/20 0.44
DYRK1A Q13627 1/20 0.44
DYRK4 Q9NR20 1/20 0.44
PDGFRB P09619 1/20 0.44
MAOA P21397 2/20 0.43
GSTP1 P09211 1/20 0.42
CDK4 P11802 2/20 0.41
CCND1 P24385 2/20 0.41
CCNA2 P20248 1/20 0.41
CDK2 P24941 1/20 0.41

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8082188 0.93 ALOX5 (0.49) ALOX5ALDH1A1KDM4ENPC1HPGD
SCHEMBL8086701 0.89 ALOX5 (0.46) ALOX5MAOBCDK1CLK1DYRK1A
SCHEMBL8072560 0.85 MAOB (0.49) ALOX5MAOBKDM4ENPC1HPGD
SCHEMBL8081532 0.85 ALOX5 (0.43) ALOX5CDK1CLK1DYRK1ADYRK4
SCHEMBL8085182 0.80 ALOX5 (0.49) ALOX5ALDH1A1KDM4ENPC1LMNA
SCHEMBL8084895 0.79 MAOB (0.53) ALOX5MAOBMAOAGSTP1CDK4
SCHEMBL8085101 0.79 ALOX5 (0.52) ALOX5MAOBALDH1A1KDM4ENPC1
SCHEMBL8086720 0.73 PDGFRB (0.51) MAOBALDH1A1KDM4ENPC1LMNA
SCHEMBL8080534 0.72 CDK1 (0.48) ALDH1A1KDM4ENPC1HPGDRAB9A
SCHEMBL7286859 0.72 GSTP1 (0.55) MAOBALDH1A1KDM4ELMNAHPGD

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6030967-A AND/OR LIKE NEUROTROPHIC FACTOR (FOR EXAMPLE, NERVE GROWTH FACTOR (NGF), BRAIN-DERIVED NEUROTROPHIC FACTOR, NEUROTROPHIN-3, AND GLIAL CELL LINE-DERIVED NEUROTROPHIC FACTOR)-LIKE ACTIVITY; OSTEOPOROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-02-29 US disclosed